3-Oxocyclopentanecarboxylic acid
Catalog No: FT-0649624
CAS No: 98-78-2
- Chemical Name: 3-Oxocyclopentanecarboxylic acid
- Molecular Formula: C6H8O3
- Molecular Weight: 128.13
- InChI Key: RDSNBKRWKBMPOP-UHFFFAOYSA-N
- InChI: InChI=1S/C6H8O3/c7-5-2-1-4(3-5)6(8)9/h4H,1-3H2,(H,8,9)
| Assay | Pack Size | Price | Stock | Action |
|---|---|---|---|---|
| 98% | 1g | N/A | N/A | |
| 98% | 5g | N/A | N/A | |
| 98% | Bulk Quantity | N/A | N/A |
| Melting_Point: | 59-62 °C(lit.) |
|---|---|
| CAS: | 98-78-2 |
| MF: | C6H8O3 |
| Flash_Point: | 149.9±22.4 °C |
| Product_Name: | 3-Oxocyclopentanecarboxylic acid |
| Density: | 1.3±0.1 g/cm3 |
| FW: | 128.126 |
| Bolling_Point: | 300.6±35.0 °C at 760 mmHg |
| Refractive_Index: | 1.513 |
|---|---|
| Vapor_Pressure: | 0.0±1.3 mmHg at 25°C |
| Flash_Point: | 149.9±22.4 °C |
| LogP: | -0.94 |
| Bolling_Point: | 300.6±35.0 °C at 760 mmHg |
| FW: | 128.126 |
| PSA: | 54.37000 |
| Computational_Chemistry: | ['1. XlogP :-04 ', '2. Hydrogen Bond Donor Count :1 ', '3. Hydrogen Bond Acceptor Count :3 ', '4. Rotatable Bond Count :1 ', '5. Isotope Atom Count :3 ', '6. TPSA 544 ', '7. Heavy Atom Count :9 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :150 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :1 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1'] |
| Melting_Point: | 59-62 °C(lit.) |
| MF: | C6H8O3 |
| Exact_Mass: | 128.047348 |
| Molecular_Structure: | ['1. Molar refractive index 2929 ', '2. Molar volume 974 ', '3. Parachor (902K)2660 ', '4. Surface tension 554 ', '5. Dielectric constant N/A ', '6. Polarizability 1161 ', '7. Single isotope mass 128047344 Da ', '8. Nominal mass 128 Da ', '9. Average mass 1281259 Da'] |
| Density: | 1.3±0.1 g/cm3 |
| More_Info: | ['1 . Appearance Solid ', '2 . Density(g/mL,25℃)Unknow ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)59-62 ', '5 . Boiling point(ºC,Atmospheric pressure)Unknow ', '6 . Boiling point(ºC,266kPa)Unknow ', '7 . Refractive indexUnknow ', '8 . Flash point(ºC)Unknow ', '9 . Specific rotation(º)Unknow ', '10 . Spontaneous ignition point or ignition temperature(ºC)Unknow ', '11 . Vapor pressure(mmHg,20ºC)Unknow ', '12 . Saturated vapor pressure(kPa,20 ºC)Unknow ', '13 . Combustion heat(KJ/mol)Unknow ', '14 . Critical temperature(ºC)Unknow ', '15 . Critical pressure(MPa)Unknow ', '16 . Oil-water(Octanol /Water )Logarithmic Value of Distribution Coefficient Unknow ', '17 . Upper limit of explosion(%,V/V)Unknow ', '18 . Lower limit of explosion(%,V/V)Unknow ', '19 . Solubility Unknow'] |
| Risk_Statements(EU): | 36/37/38 |
|---|---|
| WGK_Germany: | 3 |
| Personal_Protective_Equipment: | Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter |
| RIDADR: | NONH for all modes of transport |
| Safety_Statements: | S26-S36/37/39 |
| HS_Code: | 2918300090 |
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